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Compound InformationSONAR Target prediction
Name:

Thiamphenicol

Unique Identifier:Prest885
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C12Cl2H15NO5S
Molecular Weight:341.104 g/mol
X log p:7.295  (online calculus)
Lipinksi Failures1
TPSA59.59
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:7
Canonical Smiles:CS(=O)(=O)c1ccc(cc1)C(O)C(CO)NC(=O)C(Cl)Cl

Found: 3 nonactive as graph: single | with analogs << Back 1 2 3
Species: 9606
Condition: TMPPre003
Replicates: 2
Raw OD Value: r im 18180.0000±0
Normalized OD Score: sc h 1.0013±0
Z-Score: 0.0369±0
p-Value: 0.970542
Z-Factor: -22.6644
Fitness Defect: 0.0299
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:1|C6
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.50 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):18471.5±2737.44289
Plate DMSO Control (-):18271±1230.24317
Plate Z-Factor:-192.4333
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DBLink | Rows returned: 3
5433 2,2-dichloro-N-[1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide
27200 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide
146678 2,2-dichloro-N-[(1S,2S)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 681 | Additional Members: 8 | Rows returned: 6
Prest1164 0.524590163934426
SPE01503136 0.351851851851852
SPE01500174 0
Prest51 0
LAT002D07 0
LAT006C02 0

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